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Add function to summarize SMIRNOFF model #10

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merged 1 commit into from
Sep 13, 2021
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SimonBoothroyd
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Description

This PR adds a convenience method for summarising the initial and final values of a SMIRNOFF model that is being trained. The main example has been updated to use this improved functionality.

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  • Ready to go

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codecov bot commented Sep 13, 2021

Codecov Report

Merging #10 (1e945b0) into main (a74a086) will increase coverage by 0.04%.
The diff coverage is 100.00%.

@SimonBoothroyd SimonBoothroyd merged commit 665a67e into main Sep 13, 2021
@SimonBoothroyd SimonBoothroyd deleted the print-summary branch September 13, 2021 10:42
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